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2'-Aminomethyl-3-bromo-1,1'-biphenyl-4-methanol

HCID 21836655
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
NCc1ccccc1-c1ccc(CO)c(Br)c1
InChIKey
FIOFESCWEZLDEV-UHFFFAOYSA-N
Molecular formula
C14H14BrNO
Average molar mass
292.17 g/mol

Names & identifiers

Preferred name
2'-Aminomethyl-3-bromo-1,1'-biphenyl-4-methanol
IUPAC
[4-[2-(aminomethyl)phenyl]-2-bromophenyl]methanol

Names & synonyms

SCHEMBL7791762FIOFESCWEZLDEV-UHFFFAOYSA-N2'-Aminomethyl-3-bromo-1,1'-biphenyl-4-methanol

Database identifiers

PubChem CID
21836655

Properties

Computed structural propertiesFilling in

XLogP
2.2
Topological polar surface area
46.3 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
17
Formal charge
0
Complexity
236

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Related reactions

5 records
New reaction record
HRID 166400 reaction equation
HRID 166400As reactantTraining data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID 1379873 reaction equation
HRID 1379873As productuspto-grants-1997_09
HRID 1379874 reaction equation
HRID 1379874As reactantuspto-grants-1997_09
HRID 1740247 reaction equation
HRID 1740247As productuspto-grants-1999_10
HRID 1740248 reaction equation
HRID 1740248As reactantuspto-grants-1999_10

Compound notes

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